SCHEMBL6592153

SCHEMBL6592153

Cc1cc(N(C)C)c2cc(C3=NC(c4ccc5nc(C)cc(N(C)C)c5c4)N(N)C(N4CCN(C5CCNCC5)CC4)=N3)ccc2n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 2/20 0.38
BMPR1A P36894 2/20 0.38
ACVR1B P36896 2/20 0.38
ACVR1 Q04771 2/20 0.38
TGFBR1 P36897 1/20 0.38
TERT O14746 3/20 0.33
KHK P50053 2/20 0.33
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
ACVRL1 P37023 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4074857 0.87 TERT (0.35) ACVR1TERT
SCHEMBL6607149 0.85 TERT (0.34) TERT
SCHEMBL4082014 0.84 ACVR1 (0.34) ACVR1TERT
SCHEMBL4076584 0.84 TERT (0.33) TERT
SCHEMBL6591886 0.83 BRD4 (0.37)
SCHEMBL6594969 0.83 MEN1 (0.36) TERTTLR9TLR8TLR7
SCHEMBL6605139 0.82 TERT (0.33) TERT
SCHEMBL4076912 0.81 TLR9 (0.37) TERTTLR9TLR8TLR7
SCHEMBL6599497 0.81 SMPD3 (0.35) TERT
SCHEMBL4081928 0.81 BRD4 (0.32) TERT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed